0 B13R1.298 C=C(C)c1cc(c(c(c1)C#N)N)C 271570a_100000694244_100012771665 [0,0,0,0,0,0|4,0,0]=4 1 B13R1.298 C=C(C)c1cc(c(c(c1)C#N)N)F 271570a_100000694244_200012344957 [0,0,0,0,0,0|3,1,0]=4 2 B13R1.298 CNc1cc(cc(c1Br)C)[N+](=O)[O-] 2230a_200011072699_200000210301 [0,0,0,0,0,0|4,0,0]=4 3 B13R1.298 CNc1cc(cc(c1Br)C)[N+](=O)[O-] 34a_200011072699_200000210301 [0,0,0,0,0,0|4,0,0]=4 4 B13R1.298 CNc1cc(cc(c1Br)C)[N+](=O)[O-] 7a_200011072699_200000210301 [0,0,0,0,0,0|4,0,0]=4 5 B13R1.298 CNc1cc(cc(c1C)Br)[N+](=O)[O-] 34a_200010212519_200000210301 [0,0,0,0,0,0|3,1,0]=4 6 B13R1.298 CNc1cc(cc(c1C)Br)[N+](=O)[O-] 7a_200010212519_200000210301 [0,0,0,0,0,0|3,1,0]=4 7 B13R1.298 CNc1cc(cc(c1C)C)[N+](=O)[O-] 2230a_200000082164_200000210301 [0,0,0,0,0,0|4,0,0]=4 8 B13R1.298 CNc1cc(cc(c1C)C)[N+](=O)[O-] 34a_200000082164_200000210301 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.298 CNc1cc(cc(c1C)C)[N+](=O)[O-] 7a_200000082164_200000210301 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.298 CNc1cc(cc(c1O)Cl)[N+](=O)[O-] 7a_100000029776_200000210301 [0,0,0,0,0,0|3,1,0]=4 11 B13R1.298 COc1cc(cc(c1Cl)Cl)[N+](=O)[O-] 34a_200015510736_200000210301 [0,0,0,0,0,0|3,1,0]=4 12 B13R1.298 COc1cc(cc(c1Cl)Cl)[N+](=O)[O-] 7a_200015510736_200000210301 [0,0,0,0,0,0|3,1,0]=4 13 B13R1.298 COc1cc(cc(c1F)F)[N+](=O)[O-] 34a_200016991574_200000210301 [0,0,0,0,0,0|3,1,0]=4 14 B13R1.298 COc1cc(cc(c1F)F)[N+](=O)[O-] 7a_200016991574_200000210301 [0,0,0,0,0,0|3,1,0]=4 15 B13R1.298 COc1cc(cc(c1N)Br)[N+](=O)[O-] 7a_100010128237_200000210301 [0,0,0,0,0,0|2,1,0]=3 16 B13R1.298 Cc1c(cc(cc1N[13CH3])[N+](=O)[O-])Br 34a_200010212519_200025704644 [0,0,0,0,0,0|3,1,0]=4 17 B13R1.298 Cc1c(cc(cc1N[13CH3])[N+](=O)[O-])Br 7a_200010212519_200025704644 [0,0,0,0,0,0|3,1,0]=4 18 B13R1.298 Cc1cc(cc(c1Br)N[13CH3])[N+](=O)[O-] 2230a_200011072699_200025704644 [0,0,0,0,0,0|4,0,0]=4 19 B13R1.298 Cc1cc(cc(c1Br)N[13CH3])[N+](=O)[O-] 34a_200011072699_200025704644 [0,0,0,0,0,0|4,0,0]=4 20 B13R1.298 Cc1cc(cc(c1Br)N[13CH3])[N+](=O)[O-] 7a_200011072699_200025704644 [0,0,0,0,0,0|4,0,0]=4 21 B13R1.298 Cc1cc(cc(c1C)N[13CH3])[N+](=O)[O-] 2230a_200000082164_200025704644 [0,0,0,0,0,0|4,0,0]=4 22 B13R1.298 Cc1cc(cc(c1C)N[13CH3])[N+](=O)[O-] 34a_200000082164_200025704644 [0,0,0,0,0,0|4,0,0]=4 23 B13R1.298 Cc1cc(cc(c1C)N[13CH3])[N+](=O)[O-] 7a_200000082164_200025704644 [0,0,0,0,0,0|4,0,0]=4 24 B13R1.298 [13CH3]Nc1cc(cc(c1O)Cl)[N+](=O)[O-] 7a_100000029776_200025704644 [0,0,0,0,0,0|3,1,0]=4 25 B13R1.298 [13CH3]Oc1cc(cc(c1Cl)Cl)[N+](=O)[O-] 34a_200015510736_200025704644 [0,0,0,0,0,0|3,1,0]=4 26 B13R1.298 [13CH3]Oc1cc(cc(c1Cl)Cl)[N+](=O)[O-] 7a_200015510736_200025704644 [0,0,0,0,0,0|3,1,0]=4 27 B13R1.298 [13CH3]Oc1cc(cc(c1F)F)[N+](=O)[O-] 34a_200016991574_200025704644 [0,0,0,0,0,0|3,1,0]=4 28 B13R1.298 [13CH3]Oc1cc(cc(c1F)F)[N+](=O)[O-] 7a_200016991574_200025704644 [0,0,0,0,0,0|3,1,0]=4 29 B13R1.298 [13CH3]Oc1cc(cc(c1N)Br)[N+](=O)[O-] 7a_100010128237_200025704644 [0,0,0,0,0,0|2,1,0]=3 30 B12R1.11 CC(=O)c1cc(cc(c1)C#N)Br 1458a_100011935128_200000210301 [1,0,0,0,0,0|2,1,0]=4 31 B12R1.11 CC(=O)c1cc(cc(c1)C#N)C 1458a_100012001805_200000210301 [1,0,0,0,0,0|3,0,0]=4 32 B12R1.11 CC(=O)c1cc(cc(c1)C#N)Cl 1458a_100011997934_200000210301 [1,0,0,0,0,0|2,1,0]=4 33 B12R1.11 CC(=O)c1cc(cc(c1)C#N)F 1458a_100011356446_200000210301 [1,0,0,0,0,0|2,1,0]=4 34 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])Br 34a_100000728782_200000210301 [1,0,0,0,0,0|2,1,0]=4 35 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])Br 7a_100000728782_200000210301 [1,0,0,0,0,0|2,1,0]=4 36 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])C 2230a_100011707342_200000210301 [1,0,0,0,0,0|3,0,0]=4 37 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])C 34a_100011707342_200000210301 [1,0,0,0,0,0|3,0,0]=4 38 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])C 7a_100011707342_200000210301 [1,0,0,0,0,0|3,0,0]=4 39 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])Cl 34a_100012181248_200000210301 [1,0,0,0,0,0|2,1,0]=4 40 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])Cl 7a_100012181248_200000210301 [1,0,0,0,0,0|2,1,0]=4 41 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])F 34a_100000756922_200000210301 [1,0,0,0,0,0|2,1,0]=4 42 B12R1.11 CNc1cc(cc(c1)[N+](=O)[O-])F 7a_100000756922_200000210301 [1,0,0,0,0,0|2,1,0]=4 43 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])Br 34a_100010219246_200000210301 [1,0,0,0,0,0|2,1,0]=4 44 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])Br 7a_100010219246_200000210301 [1,0,0,0,0,0|2,1,0]=4 45 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])C 34a_200000091708_200000210301 [1,0,0,0,0,0|3,0,0]=4 46 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])C 7a_200000091708_200000210301 [1,0,0,0,0,0|3,0,0]=4 47 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])Cl 34a_100000118981_200000210301 [1,0,0,0,0,0|2,1,0]=4 48 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])Cl 7a_100000118981_200000210301 [1,0,0,0,0,0|2,1,0]=4 49 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])F 34a_100000690918_200000210301 [1,0,0,0,0,0|2,1,0]=4 50 B12R1.11 COc1cc(cc(c1)[N+](=O)[O-])F 7a_100000690918_200000210301 [1,0,0,0,0,0|2,1,0]=4 51 B12R1.11 Cc1cc(cc(c1)C(=O)[13CH3])C#N 1458a_100012001805_200025704644 [1,0,0,0,0,0|3,0,0]=4 52 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])N[13CH3] 2230a_100011707342_200025704644 [1,0,0,0,0,0|3,0,0]=4 53 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])N[13CH3] 34a_100011707342_200025704644 [1,0,0,0,0,0|3,0,0]=4 54 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])N[13CH3] 7a_100011707342_200025704644 [1,0,0,0,0,0|3,0,0]=4 55 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])O[13CH3] 34a_200000091708_200025704644 [1,0,0,0,0,0|3,0,0]=4 56 B12R1.11 Cc1cc(cc(c1)[N+](=O)[O-])O[13CH3] 7a_200000091708_200025704644 [1,0,0,0,0,0|3,0,0]=4 57 B12R1.11 [13CH3]C(=O)c1cc(cc(c1)C#N)Br 1458a_100011935128_200025704644 [1,0,0,0,0,0|2,1,0]=4 58 B12R1.11 [13CH3]C(=O)c1cc(cc(c1)C#N)Cl 1458a_100011997934_200025704644 [1,0,0,0,0,0|2,1,0]=4 59 B12R1.11 [13CH3]C(=O)c1cc(cc(c1)C#N)F 1458a_100011356446_200025704644 [1,0,0,0,0,0|2,1,0]=4 60 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])Br 34a_100000728782_200025704644 [1,0,0,0,0,0|2,1,0]=4 61 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])Br 7a_100000728782_200025704644 [1,0,0,0,0,0|2,1,0]=4 62 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])Cl 34a_100012181248_200025704644 [1,0,0,0,0,0|2,1,0]=4 63 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])Cl 7a_100012181248_200025704644 [1,0,0,0,0,0|2,1,0]=4 64 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])F 34a_100000756922_200025704644 [1,0,0,0,0,0|2,1,0]=4 65 B12R1.11 [13CH3]Nc1cc(cc(c1)[N+](=O)[O-])F 7a_100000756922_200025704644 [1,0,0,0,0,0|2,1,0]=4 66 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])Br 34a_100010219246_200025704644 [1,0,0,0,0,0|2,1,0]=4 67 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])Br 7a_100010219246_200025704644 [1,0,0,0,0,0|2,1,0]=4 68 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])Cl 34a_100000118981_200025704644 [1,0,0,0,0,0|2,1,0]=4 69 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])Cl 7a_100000118981_200025704644 [1,0,0,0,0,0|2,1,0]=4 70 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])F 34a_100000690918_200025704644 [1,0,0,0,0,0|2,1,0]=4 71 B12R1.11 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])F 7a_100000690918_200025704644 [1,0,0,0,0,0|2,1,0]=4 72 B12R1.56 C=C(C)c1ccc(c(c1)C#N)N 271570a_100000694244_100000688460 [1,0,0,0,0,0|3,0,0]=4 73 B12R1.56 CC(=O)c1ccc(c(c1)C#N)Br 1458a_100010253904_200000210301 [1,0,0,0,0,0|3,0,0]=4 74 B12R1.56 CC(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_200000210301 [1,0,0,0,0,0|3,0,0]=4 75 B12R1.56 CC(=O)c1ccc(c(c1)C#N)F 1458a_100000697239_200000210301 [1,0,0,0,0,0|3,0,0]=4 76 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200000210301 [1,0,0,0,0,0|3,0,0]=4 77 B12R1.56 CC(=O)c1ccc(c(c1)C#N)O 271570a_203496583355_100010125495 [1,0,0,0,0,0|3,0,0]=4 78 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] 34a_100000184112_200000210301 [1,0,0,0,0,0|3,0,0]=4 79 B12R1.56 CNc1cc(ccc1C)[N+](=O)[O-] 7a_100000184112_200000210301 [1,0,0,0,0,0|3,0,0]=4 80 B12R1.56 CNc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000186089_200000210301 [1,0,0,0,0,0|3,0,0]=4 81 B12R1.56 CNc1cc(ccc1F)[N+](=O)[O-] 34a_100000185768_200000210301 [1,0,0,0,0,0|3,0,0]=4 82 B12R1.56 CNc1cc(ccc1O)[N+](=O)[O-] 7a_100000181223_200000210301 [1,0,0,0,0,0|3,0,0]=4 83 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] 34a_100000691124_200000210301 [1,0,0,0,0,0|3,0,0]=4 84 B12R1.56 COc1cc(ccc1Br)[N+](=O)[O-] 7a_100000691124_200000210301 [1,0,0,0,0,0|3,0,0]=4 85 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] 34a_100000740739_200000210301 [1,0,0,0,0,0|3,0,0]=4 86 B12R1.56 COc1cc(ccc1C)[N+](=O)[O-] 7a_100000740739_200000210301 [1,0,0,0,0,0|3,0,0]=4 87 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000188705_200000210301 [1,0,0,0,0,0|3,0,0]=4 88 B12R1.56 COc1cc(ccc1Cl)[N+](=O)[O-] 7a_100000188705_200000210301 [1,0,0,0,0,0|3,0,0]=4 89 B12R1.56 COc1cc(ccc1F)[N+](=O)[O-] 34a_100011294461_200000210301 [1,0,0,0,0,0|3,0,0]=4 90 B12R1.56 COc1cc(ccc1F)[N+](=O)[O-] 7a_100011294461_200000210301 [1,0,0,0,0,0|3,0,0]=4 91 B12R1.56 COc1cc(ccc1I)[N+](=O)[O-] 34a_100000072739_200000210301 [1,0,0,0,0,0|3,0,0]=4 92 B12R1.56 COc1cc(ccc1I)[N+](=O)[O-] 7a_100000072739_200000210301 [1,0,0,0,0,0|3,0,0]=4 93 B12R1.56 COc1cc(ccc1N)[N+](=O)[O-] 34a_100000210499_200000210301 [1,0,0,0,0,0|2,0,0]=3 94 B12R1.56 COc1cc(ccc1N)[N+](=O)[O-] 7a_100000210499_200000210301 [1,0,0,0,0,0|2,0,0]=3 95 B12R1.56 COc1cc(cnc1N)[N+](=O)[O-] 34a_100009863383_200000210301 [1,0,0,0,0,0|3,0,0]=4 96 B12R1.56 COc1cc(cnc1N)[N+](=O)[O-] 7a_100009863383_200000210301 [1,0,0,0,0,0|3,0,0]=4 97 B12R1.56 Cc1ccc(cc1N[13CH3])[N+](=O)[O-] 34a_100000184112_200025704644 [1,0,0,0,0,0|3,0,0]=4 98 B12R1.56 Cc1ccc(cc1N[13CH3])[N+](=O)[O-] 7a_100000184112_200025704644 [1,0,0,0,0,0|3,0,0]=4 99 B12R1.56 Cc1ccc(cc1O[13CH3])[N+](=O)[O-] 34a_100000740739_200025704644 [1,0,0,0,0,0|3,0,0]=4 100 B12R1.56 Cc1ccc(cc1O[13CH3])[N+](=O)[O-] 7a_100000740739_200025704644 [1,0,0,0,0,0|3,0,0]=4 101 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)Br 1458a_100010253904_200025704644 [1,0,0,0,0,0|3,0,0]=4 102 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)Cl 1458a_100000696165_200025704644 [1,0,0,0,0,0|3,0,0]=4 103 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)F 1458a_100000697239_200025704644 [1,0,0,0,0,0|3,0,0]=4 104 B12R1.56 [13CH3]C(=O)c1ccc(c(c1)C#N)O 1458a_100009875055_200025704644 [1,0,0,0,0,0|3,0,0]=4 105 B12R1.56 [13CH3]Nc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000186089_200025704644 [1,0,0,0,0,0|3,0,0]=4 106 B12R1.56 [13CH3]Nc1cc(ccc1F)[N+](=O)[O-] 34a_100000185768_200025704644 [1,0,0,0,0,0|3,0,0]=4 107 B12R1.56 [13CH3]Nc1cc(ccc1O)[N+](=O)[O-] 7a_100000181223_200025704644 [1,0,0,0,0,0|3,0,0]=4 108 B12R1.56 [13CH3]Oc1cc(ccc1Br)[N+](=O)[O-] 34a_100000691124_200025704644 [1,0,0,0,0,0|3,0,0]=4 109 B12R1.56 [13CH3]Oc1cc(ccc1Br)[N+](=O)[O-] 7a_100000691124_200025704644 [1,0,0,0,0,0|3,0,0]=4 110 B12R1.56 [13CH3]Oc1cc(ccc1Cl)[N+](=O)[O-] 34a_100000188705_200025704644 [1,0,0,0,0,0|3,0,0]=4 111 B12R1.56 [13CH3]Oc1cc(ccc1Cl)[N+](=O)[O-] 7a_100000188705_200025704644 [1,0,0,0,0,0|3,0,0]=4 112 B12R1.56 [13CH3]Oc1cc(ccc1F)[N+](=O)[O-] 34a_100011294461_200025704644 [1,0,0,0,0,0|3,0,0]=4 113 B12R1.56 [13CH3]Oc1cc(ccc1F)[N+](=O)[O-] 7a_100011294461_200025704644 [1,0,0,0,0,0|3,0,0]=4 114 B12R1.56 [13CH3]Oc1cc(ccc1I)[N+](=O)[O-] 34a_100000072739_200025704644 [1,0,0,0,0,0|3,0,0]=4 115 B12R1.56 [13CH3]Oc1cc(ccc1I)[N+](=O)[O-] 7a_100000072739_200025704644 [1,0,0,0,0,0|3,0,0]=4 116 B12R1.56 [13CH3]Oc1cc(ccc1N)[N+](=O)[O-] 34a_100000210499_200025704644 [1,0,0,0,0,0|2,0,0]=3 117 B12R1.56 [13CH3]Oc1cc(ccc1N)[N+](=O)[O-] 7a_100000210499_200025704644 [1,0,0,0,0,0|2,0,0]=3 118 B12R1.56 [13CH3]Oc1cc(cnc1N)[N+](=O)[O-] 34a_100009863383_200025704644 [1,0,0,0,0,0|3,0,0]=4 119 B12R1.56 [13CH3]Oc1cc(cnc1N)[N+](=O)[O-] 7a_100009863383_200025704644 [1,0,0,0,0,0|3,0,0]=4 120 B12R1.300 C=Cc1cc(c(c(c1)C#N)N)C 271570a_100011290941_100012771665 [1,0,0,0,0,0|3,0,0]=4 121 B12R1.300 C=Cc1cc(c(c(c1)C#N)N)F 271570a_100011290941_200012344957 [1,0,0,0,0,0|2,1,0]=4 122 B12R1.300 CSc1cc(c(c(c1)C#N)N)C 62a_200000210301_100012771665 [1,0,0,0,0,0|3,0,0]=4 123 B12R1.300 CSc1cc(c(c(c1)C#N)N)F 62a_200000210301_200012344957 [1,0,0,0,0,0|2,1,0]=4 124 B12R1.300 Cc1cc(cc(c1N)C#N)S[13CH3] 62a_200025704644_100012771665 [1,0,0,0,0,0|3,0,0]=4 125 B12R1.300 [13CH3]Sc1cc(c(c(c1)C#N)N)F 62a_200025704644_200012344957 [1,0,0,0,0,0|2,1,0]=4 126 B14R1.350 CNc1c(cc(cc1C#N)[N+](=O)[O-])Cl 7a_100000030214_200000210301 [0,1,0,0,0,0|0,1,0]=2 127 B14R1.350 CNc1c(cc(cc1OC)[N+](=O)[O-])C 34a_100011086007_200000210301 [0,1,0,0,0,0|3,0,0]=4 128 B14R1.350 COc1cc(cc(c1N[13CH3])C)[N+](=O)[O-] 34a_100011086007_200025704644 [0,1,0,0,0,0|3,0,0]=4 129 B14R1.350 [13CH3]Nc1c(cc(cc1C#N)[N+](=O)[O-])Cl 7a_100000030214_200025704644 [0,1,0,0,0,0|0,1,0]=2 130 B14R1.5293 CCOc1cc(cc(c1N)Br)[N+](=O)[O-] 7a_100010128237_100000210202 [0,1,0,0,0,0|1,1,1]=4 131 B14R1.5293 Nc1c(cc(cc1OCF)[N+](=O)[O-])Br 7a_100010128237_100015361967 [0,1,0,0,0,0|1,1,1]=4 132 B11R1.9 N#Cc1cc(cc(c1)C=O)O 271570a_203496583355_100009814813 [2,0,0,0,0,0|2,0,0]=4 133 B11R1.266 CC(=O)c1cccc(c1)C#N 1458a_100000183950_200000210301 [2,0,0,0,0,0|2,0,0]=4 134 B11R1.266 CNc1cccc(c1)[N+](=O)[O-] 34a_100000184103_200000210301 [2,0,0,0,0,0|2,0,0]=4 135 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200000210301 [2,0,0,0,0,0|2,0,0]=4 136 B11R1.266 COc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200000210301 [2,0,0,0,0,0|2,0,0]=4 137 B11R1.266 [13CH3]C(=O)c1cccc(c1)C#N 1458a_100000183950_200025704644 [2,0,0,0,0,0|2,0,0]=4 138 B11R1.266 [13CH3]Nc1cccc(c1)[N+](=O)[O-] 34a_100000184103_200025704644 [2,0,0,0,0,0|2,0,0]=4 139 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 34a_100000185994_200025704644 [2,0,0,0,0,0|2,0,0]=4 140 B11R1.266 [13CH3]Oc1cccc(c1)[N+](=O)[O-] 7a_100000185994_200025704644 [2,0,0,0,0,0|2,0,0]=4 141 B11R1.280 C=Cc1ccc(c(c1)C#N)N 271570a_100011290941_100000688460 [2,0,0,0,0,0|2,0,0]=4 142 B11R1.280 COc1ccc(c(c1)C#N)N 34a_200011997737_200000210301 [2,0,0,0,0,0|2,0,0]=4 143 B11R1.280 COc1ccc(c(c1)C#N)N 7a_200011997737_200000210301 [2,0,0,0,0,0|2,0,0]=4 144 B11R1.280 CSc1ccc(c(c1)C#N)N 62a_200000210301_100000688460 [2,0,0,0,0,0|2,0,0]=4 145 B11R1.280 N#Cc1cc(ccc1O)C=O 271570a_203496583355_100010128726 [2,0,0,0,0,0|2,0,0]=4 146 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)N 34a_200011997737_200025704644 [2,0,0,0,0,0|2,0,0]=4 147 B11R1.280 [13CH3]Oc1ccc(c(c1)C#N)N 7a_200011997737_200025704644 [2,0,0,0,0,0|2,0,0]=4 148 B11R1.280 [13CH3]Sc1ccc(c(c1)C#N)N 62a_200025704644_100000688460 [2,0,0,0,0,0|2,0,0]=4 149 B11R1.8 Cc1cc(cc(c1N)C#N)O 271570a_203496583355_100012771665 [2,0,0,0,0,0|1,0,1]=4 150 B11R1.8 N#Cc1cc(cc(c1N)F)O 271570a_203496583355_200012344957 [2,0,0,0,0,0|0,1,1]=4 151 B11R1.8 N#Cc1cc(cc(c1N)O)Br 271570a_203496583355_200010208226 [2,0,0,0,0,0|2,0,0]=4 152 B11R1.8 N#Cc1cc(cc(c1N)O)F 271570a_203496583355_100013085293 [2,0,0,0,0,0|2,0,0]=4 153 B13R1.31 CNCc1cc(cc(c1)[N+](=O)[O-])I 207a_100102657272_100000732959 [1,1,0,0,0,0|0,0,2]=4 154 B13R1.31 CNCc1cc(cc(c1)[N+](=O)[O-])I 2230a_106832991635_100010150304 [1,1,0,0,0,0|0,0,2]=4 155 B13R1.31 CNCc1cc(cc(c1)[N+](=O)[O-])I 270004a_106832991635_100000732959 [1,1,0,0,0,0|0,0,2]=4 156 B13R1.31 CNCc1cc(cc(c1)[N+](=O)[O-])I 34a_100102657272_100010150304 [1,1,0,0,0,0|0,0,2]=4 157 B13R1.31 CNCc1cc(cc(c1)[N+](=O)[O-])I 7a_106832991635_100010150304 [1,1,0,0,0,0|0,0,2]=4 158 B13R1.31 COCc1cc(cc(c1)[N+](=O)[O-])I 34a_100138415774_100010150304 [1,1,0,0,0,0|1,0,1]=4 159 B13R1.31 COCc1cc(cc(c1)[N+](=O)[O-])I 7a_100000731454_200000210301 [1,1,0,0,0,0|1,0,1]=4 160 B13R1.31 CSCc1cc(cc(c1)[N+](=O)[O-])I 62a_100010150304_200000210301 [1,1,0,0,0,0|1,0,1]=4 161 B13R1.31 CSCc1cc(cc(c1)[N+](=O)[O-])I 62a_200000210301_100010150304 [1,1,0,0,0,0|1,0,1]=4 162 B13R1.31 [13CH3]OCc1cc(cc(c1)[N+](=O)[O-])I 7a_100000731454_200025704644 [1,1,0,0,0,0|1,0,1]=4 163 B13R1.31 [13CH3]SCc1cc(cc(c1)[N+](=O)[O-])I 62a_100010150304_200025704644 [1,1,0,0,0,0|1,0,1]=4 164 B13R1.31 [13CH3]SCc1cc(cc(c1)[N+](=O)[O-])I 62a_200025704644_100010150304 [1,1,0,0,0,0|1,0,1]=4 165 B13R1.126 CC(=O)c1cc(cc(c1)[N+](=O)[O-])I 1458a_100000695263_200000210301 [1,1,0,0,0,0|1,0,1]=4 166 B13R1.126 [13CH3]C(=O)c1cc(cc(c1)[N+](=O)[O-])I 1458a_100000695263_200025704644 [1,1,0,0,0,0|1,0,1]=4 167 B13R1.313 COc1cc(cc(c1)[N+](=O)[O-])C#N 34a_100000070094_200000210301 [1,1,0,0,0,0|1,0,0]=3 168 B13R1.313 COc1cc(cc(c1)[N+](=O)[O-])C#N 7a_100000070094_200000210301 [1,1,0,0,0,0|1,0,0]=3 169 B13R1.313 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])C#N 34a_100000070094_200025704644 [1,1,0,0,0,0|1,0,0]=3 170 B13R1.313 [13CH3]Oc1cc(cc(c1)[N+](=O)[O-])C#N 7a_100000070094_200025704644 [1,1,0,0,0,0|1,0,0]=3 171 B13R1.354 CCOc1cc(ccc1N)[N+](=O)[O-] 34a_100000210499_100000210202 [1,1,0,0,0,0|1,0,1]=4 172 B13R1.354 CCOc1cc(ccc1N)[N+](=O)[O-] 7a_100000210499_100000210202 [1,1,0,0,0,0|1,0,1]=4 173 B13R1.354 Nc1ccc(cc1OCF)[N+](=O)[O-] 34a_100000210499_100015361967 [1,1,0,0,0,0|1,0,1]=4 174 B13R1.354 Nc1ccc(cc1OCF)[N+](=O)[O-] 7a_100000210499_100015361967 [1,1,0,0,0,0|1,0,1]=4 175 B13R1.651 COc1cc(c(cc1N)Cl)[N+](=O)[O-] 7a_100000211395_200000210301 [1,1,0,0,0,0|2,0,0]=4 176 B13R1.651 [13CH3]Oc1cc(c(cc1N)Cl)[N+](=O)[O-] 7a_100000211395_200025704644 [1,1,0,0,0,0|2,0,0]=4 177 B13R1.3091 CNc1ccc(cc1C#N)C(=O)C 27a_100102657272_100010125495 [1,1,0,0,0,0|2,0,0]=4 178 B13R1.3091 CNc1ccc(cc1C#N)[N+](=O)[O-] 7a_100000188651_200000210301 [1,1,0,0,0,0|0,0,0]=2 179 B13R1.3091 CNc1ccc(cc1OC)[N+](=O)[O-] 34a_100000211086_200000210301 [1,1,0,0,0,0|2,0,0]=4 180 B13R1.3091 COc1cc(ccc1N[13CH3])[N+](=O)[O-] 34a_100000211086_200025704644 [1,1,0,0,0,0|2,0,0]=4 181 B13R1.3091 COc1ccc(cc1C#N)[N+](=O)[O-] 34a_100000742360_200000210301 [1,1,0,0,0,0|1,0,0]=3 182 B13R1.3091 COc1ccc(cc1C#N)[N+](=O)[O-] 7a_100000742360_200000210301 [1,1,0,0,0,0|1,0,0]=3 183 B13R1.3091 [13CH3]Nc1ccc(cc1C#N)[N+](=O)[O-] 7a_100000188651_200025704644 [1,1,0,0,0,0|0,0,0]=2 184 B13R1.3091 [13CH3]Oc1ccc(cc1C#N)[N+](=O)[O-] 34a_100000742360_200025704644 [1,1,0,0,0,0|1,0,0]=3 185 B13R1.3091 [13CH3]Oc1ccc(cc1C#N)[N+](=O)[O-] 7a_100000742360_200025704644 [1,1,0,0,0,0|1,0,0]=3 186 B13R1.3380 CNc1c(cc(cc1Br)[N+](=O)[O-])C 7a_100009813865_200000210301 [1,1,0,0,0,0|0,1,1]=4 187 B13R1.3380 CNc1c(cc(cc1C)[N+](=O)[O-])C 34a_100000765414_200000210301 [1,1,0,0,0,0|1,0,1]=4 188 B13R1.3380 CNc1c(cc(cc1C)[N+](=O)[O-])C 7a_100000765414_200000210301 [1,1,0,0,0,0|1,0,1]=4 189 B13R1.3380 CNc1c(cc(cc1Cl)[N+](=O)[O-])C 7a_100011218544_200000210301 [1,1,0,0,0,0|0,1,1]=4 190 B13R1.3380 CNc1c(cc(cc1F)[N+](=O)[O-])F 34a_100011217156_200000210301 [1,1,0,0,0,0|1,1,0]=4 191 B13R1.3380 COc1c(cc(cc1I)[N+](=O)[O-])I 7a_100000032127_200000210301 [1,1,0,0,0,0|2,0,0]=4 192 B13R1.3380 Cc1cc(cc(c1N[13CH3])Br)[N+](=O)[O-] 7a_100009813865_200025704644 [1,1,0,0,0,0|0,1,1]=4 193 B13R1.3380 Cc1cc(cc(c1N[13CH3])C)[N+](=O)[O-] 34a_100000765414_200025704644 [1,1,0,0,0,0|1,0,1]=4 194 B13R1.3380 Cc1cc(cc(c1N[13CH3])C)[N+](=O)[O-] 7a_100000765414_200025704644 [1,1,0,0,0,0|1,0,1]=4 195 B13R1.3380 Cc1cc(cc(c1N[13CH3])Cl)[N+](=O)[O-] 7a_100011218544_200025704644 [1,1,0,0,0,0|0,1,1]=4 196 B13R1.3380 [13CH3]Nc1c(cc(cc1F)[N+](=O)[O-])F 34a_100011217156_200025704644 [1,1,0,0,0,0|1,1,0]=4 197 B13R1.3380 [13CH3]Oc1c(cc(cc1I)[N+](=O)[O-])I 7a_100000032127_200025704644 [1,1,0,0,0,0|2,0,0]=4 198 B15R1.27171 CCNc1c(cc(cc1C#N)[N+](=O)[O-])Cl 7a_100000030214_100000210202 [0,2,0,0,0,0|0,1,0]=3 199 B15R1.27171 N#Cc1cc(cc(c1NCF)Cl)[N+](=O)[O-] 7a_100000030214_100015361967 [0,2,0,0,0,0|0,1,0]=3 200 B15R1.10943 C#CCOc1cc(cc(c1N)Br)[N+](=O)[O-] 7a_100010128237_100000038162 [0,2,0,0,0,0|1,1,0]=4 201 B15R1.10943 Cc1c(cc(cc1NCC#N)[N+](=O)[O-])Br 7a_200010212519_100011215382 [0,2,0,0,0,0|1,1,0]=4 202 B15R1.10943 Cc1cc(cc(c1Br)NCC#N)[N+](=O)[O-] 2230a_200011072699_100011215382 [0,2,0,0,0,0|2,0,0]=4 203 B15R1.10943 Cc1cc(cc(c1Br)NCC#N)[N+](=O)[O-] 7a_200011072699_100011215382 [0,2,0,0,0,0|2,0,0]=4 204 B15R1.10943 Cc1cc(cc(c1C)NCC#N)[N+](=O)[O-] 2230a_200000082164_100011215382 [0,2,0,0,0,0|2,0,0]=4 205 B15R1.10943 Cc1cc(cc(c1C)NCC#N)[N+](=O)[O-] 7a_200000082164_100011215382 [0,2,0,0,0,0|2,0,0]=4 206 B15R1.10943 N#CCNc1cc(cc(c1O)Cl)[N+](=O)[O-] 7a_100000029776_100011215382 [0,2,0,0,0,0|1,1,0]=4 207 B15R1.10943 N#CCOc1cc(cc(c1Cl)Cl)[N+](=O)[O-] 7a_200015510736_100011215382 [0,2,0,0,0,0|1,1,0]=4 208 B15R1.10943 N#CCOc1cc(cc(c1F)F)[N+](=O)[O-] 7a_200016991574_100011215382 [0,2,0,0,0,0|1,1,0]=4 209 B15R1.10943 N#CCOc1cc(cc(c1N)Br)[N+](=O)[O-] 7a_100010128237_100011215382 [0,2,0,0,0,0|0,1,0]=3 210 B15R1.392 Cc1cc(cc(c1N)C#N)SCC(=O)[O-] 62a_100020667443_100012771665 [0,0,0,0,0,2|2,0,0]=4 211 B15R1.392 N#Cc1cc(cc(c1F)F)NC[N+](=O)[O-] 34a_100009986430_100000761209 [0,0,0,0,0,2|1,1,0]=4 212 B15R1.392 N#Cc1cc(cc(c1N)F)SCC(=O)[O-] 62a_100020667443_200012344957 [0,0,0,0,0,2|1,1,0]=4